1-{2-[(5-chloro-2-methylphenyl)carbamamido]ethyl}-N,N-dimethyl-1H-benzotriazole-5-sulfonamide
Chemical Structure Depiction of
1-{2-[(5-chloro-2-methylphenyl)carbamamido]ethyl}-N,N-dimethyl-1H-benzotriazole-5-sulfonamide
1-{2-[(5-chloro-2-methylphenyl)carbamamido]ethyl}-N,N-dimethyl-1H-benzotriazole-5-sulfonamide
Compound characteristics
| Compound ID: | L447-0181 |
| Compound Name: | 1-{2-[(5-chloro-2-methylphenyl)carbamamido]ethyl}-N,N-dimethyl-1H-benzotriazole-5-sulfonamide |
| Molecular Weight: | 436.92 |
| Molecular Formula: | C18 H21 Cl N6 O3 S |
| Smiles: | Cc1ccc(cc1NC(NCCn1c2ccc(cc2nn1)S(N(C)C)(=O)=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.1582 |
| logD: | 2.1581 |
| logSw: | -3.2088 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.347 |
| InChI Key: | YDOQKFFIEQXFPC-UHFFFAOYSA-N |